Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.39 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 3/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSH | P09668 | 1/20 | 0.39 |
| ▸ | TACR3 | P29371 | 5/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.37 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.36 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9540182 | 0.84 | KDM4E (0.41) | KDM4EKMT2AL3MBTL1CTSKCTSL | |
| SCHEMBL9538882 | 0.80 | GABRA1 (0.41) | KDM4EKMT2AL3MBTL1TACR3CYP3A4 | |
| SCHEMBL9540664 | 0.79 | TACR1 (0.55) | TACR3TACR1 | |
| SCHEMBL9540669 | 0.79 | TACR1 (0.55) | TACR3TACR1 | |
| SCHEMBL9538034 | 0.69 | TACR3 (0.54) | TACR3TACR1 | |
| SCHEMBL9338635 | 0.69 | TACR1 (0.55) | TACR3TACR1 | |
| SCHEMBL9399661 | 0.69 | CYP3A4 (0.68) | KDM4EKMT2ACYSLTR2CYSLTR1CYP3A4 | |
| SCHEMBL9539374 | 0.68 | TACR3 (0.45) | KDM4EKMT2AL3MBTL1LPAR1LPAR3 | |
| SCHEMBL7668995 | 0.66 | MAPK1 (0.45) | KMT2ACYP3A4MAPK1ALDH1A1 | |
| SCHEMBL9399648 | 0.66 | CYP1A2 (0.48) | KDM4EKMT2ACYSLTR2CYSLTR1CYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1993003721-A1 | CHOLECYSTOKININ ANTAGONISTS USEFUL FOR TREATING DEPRESSION | WARNER-LAMBERT COMPANY (US) | 1993-03-04 | — | — | WO | disclosed |